SCHEMBL340797

SCHEMBL340797

O=C(Cc1ccc(OCc2ccccc2)cc1)N(Cc1ccc(F)cc1)C1CCN(CCC2OCCCO2)CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 7/20 0.53
TMEM97 Q5BJF2 2/20 0.53
CCR5 P51681 2/20 0.51
HTR2A P28223 7/20 0.47
CHRM4 P08173 1/20 0.44
ALOX5 P09917 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Cadaverine Tartrate SCHEMBL5927552 0.95 CCR5 (0.49) OPRM1TMEM97CCR5HTR2A
SCHEMBL340360 0.92 OPRM1 (0.61) OPRM1TMEM97CCR5
Oxalic Acid SCHEMBL10322056 0.91 OPRM1 (0.59) OPRM1TMEM97CCR5
SCHEMBL341230 0.90 HTR2A (0.58) OPRM1TMEM97CCR5HTR2A
Oxalic Acid SCHEMBL10322235 0.89 HTR2A (0.56) OPRM1TMEM97CCR5HTR2A
SCHEMBL340417 0.89 OPRM1 (0.54) OPRM1TMEM97CCR5HTR2A
SCHEMBL342375 0.88 HTR2A (0.50) OPRM1TMEM97HTR2A
Oxalic Acid SCHEMBL10321753 0.88 HTR2A (0.48) OPRM1TMEM97HTR2A
SCHEMBL342191 0.88 HTR2A (0.55) OPRM1TMEM97CCR5HTR2A
SCHEMBL341353 0.87 OPRM1 (0.53) OPRM1TMEM97CCR5HTR2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060205722-A1 N-substituted piperidine derivatives as serotonin receptor agents ACADIA PHARMACEUTICALS, INC. 2006-09-14 US claimed
US-20060199818-A1 N-substituted piperidine derivatives as serotonin receptor agents ACADIA PHARMACEUTICALS INC. 2006-09-07 US claimed
US-20060094758-A1 N-substituted piperidine derivatives as serotonin receptor agents ACADIA PHARMACEUTICALS, INC. 2006-05-04 US claimed
US-6936395-B2 Image receiving sheet for fixing belt type electrophotography and image forming method using the same FUJI PHOTO FILM CO., LTD. (JP) 2005-08-30 US claimed
EP-1562937-A2 N-SUBSTITUTED PIPERIDINE DERIVATIVES AS SEROTONIN RECEPTOR AGENTS Acadia Pharmaceuticals Inc. (US) 2005-08-17 EP claimed
US-20050170155-A1 Image recording media and image recording method FUJI PHOTO FILM, CO., LTD (JP) 2005-08-04 US claimed
US-20040106600-A1 N-substituted piperidine derivatives as serotonin receptor agents ACADIA PHARMACEUTICALS, INC. 2004-06-03 US claimed
US-20040043240-A1 Image receiving sheet for fixing belt type electrophotography and image forming method using the same FUJIFILM CORPORATION (JP) 2004-03-04 US claimed
WO-2004000808-A2 N-SUBSTITUTED PIPERIDINE DERIVATIVES AS SEROTONIN RECEPTOR AGENTS ACADIA PHARMACEUTICALS INC. (US) 2003-12-31 WO claimed
US-20120122874-A1 COMBINATION OF A SEDATIVE AND A NEUROTRANSMITTER MODULATOR, AND METHODS FOR TREATING DEPRESSION Sunovion Inc. (US) 2012-05-17 US disclosed
US-8097625-B2 Combination of sedative and a neurotransmitter modulator, and methods for improving sleep quality and treating depression SUNOVION PHARMACEUTICALS INC. (US) 2012-01-17 US disclosed
EP-2343073-A2 Combination of a sedative and a neurotransmitter modulator, and methods for improving sleep quality and treating depression Sepracor Inc. (US) 2011-07-13 EP disclosed
US-7538222-B2 N-substituted piperidine derivatives as serotonin receptor agents ACADIA PHARMACEUTICALS, INC. (US) 2009-05-26 US disclosed
US-7476682-B2 N-substituted piperidine derivatives as serotonin receptor agents ACADIA PHARMACEUTICALS, INC. (US) 2009-01-13 US disclosed
US-20050170155-A1 Image recording media and image recording method FUJI PHOTO FILM, CO., LTD (JP) 2005-08-04 US disclosed
WO-2005060968-A1 COMBINATION OF A SEDATIVE AND A NEUROTRANSMITTER MODULATOR, AND METHODS FOR IMPROVING SLEEP QUALITY AND TREATING DEPRESSION SEPRACOR INC. (US) 2005-07-07 WO disclosed
US-20040229044-A1 toner receiver layers on substrate sheets having of high quality surface gloss and flexibility, for use in electrography FUJIFILM CORPORATION (JP) 2004-11-18 US disclosed
US-20040106600-A1 N-substituted piperidine derivatives as serotonin receptor agents ACADIA PHARMACEUTICALS, INC. 2004-06-03 US disclosed
US-20040043240-A1 Image receiving sheet for fixing belt type electrophotography and image forming method using the same FUJIFILM CORPORATION (JP) 2004-03-04 US disclosed
WO-2004000808-A2 N-SUBSTITUTED PIPERIDINE DERIVATIVES AS SEROTONIN RECEPTOR AGENTS ACADIA PHARMACEUTICALS INC. (US) 2003-12-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040106600-A1 N-substituted piperidine derivatives as serotonin receptor agents HTR1A, HTR5A, HTR1B OPRM1 40/4885TMEM97 142/4885CCR5 1728/4885
US-20060094758-A1 N-substituted piperidine derivatives as serotonin receptor agents HTR1A, HTR5A, HTR1B OPRM1 40/4885TMEM97 130/4885CCR5 1560/4885
US-20120122874-A1 COMBINATION OF A SEDATIVE AND A NEUROTRANSMITTER MODULATOR, AND METHODS FOR TREATING DEPRESSION HTR2A, HTR5A, HTR2C OPRM1 93/4885TMEM97 171/4885CCR5 553/4885
US-20060205722-A1 N-substituted piperidine derivatives as serotonin receptor agents HTR1A, HTR5A, HTR1B OPRM1 40/4885TMEM97 130/4885CCR5 1560/4885
US-20060199818-A1 N-substituted piperidine derivatives as serotonin receptor agents HTR1A, HTR5A, HTR1B OPRM1 40/4885TMEM97 130/4885CCR5 1560/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.